Sugi Predict

Sugi Predict / Compounds / SCHEMBL888659

SCHEMBL888659

SCHEMBL888659

CC(=O)OCC(COC(C)=O)COC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.50
▸ LMNA P02545 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ TSHR P16473 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ CHRM5 P08912 2/20 0.40
▸ CHRM1 P11229 2/20 0.40
▸ CHRM3 P20309 2/20 0.40
▸ PGR P06401 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ CHRM4 P08173 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ CHRNB2 P17787 1/20 0.40
▸ TBXA2R P21731 1/20 0.40
▸ CHRNB4 P30926 1/20 0.40
▸ CHRNA3 P32297 1/20 0.40
▸ CHRNA7 P36544 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ CHRNA10 Q9GZZ6 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13459987 0.86 TDP1 (0.45) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL12889164 0.86 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL27305 0.86 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL5358516 0.86 TDP1 (0.45) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL23049638 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL12903591 0.85 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL2477734 0.84 TDP1 (0.43) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL13615066 0.84 TDP1 (0.43) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL9834948 0.84 TDP1 (0.43) ALDH1A1LMNAHSD17B10TDP1TSHR
SCHEMBL9836081 0.84 TDP1 (0.43) ALDH1A1LMNAHSD17B10TDP1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1443046-B1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2008-12-17 — — EP claimed
US-7375115-B2 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-05-20 — — US claimed
US-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 — — US claimed
EP-1443046-A1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME Kyorin Pharmaceutical Co., Ltd. (JP) 2004-08-04 — — EP claimed
US-9840479-B2 Polyamine-fatty acid derived lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-12-12 — — US disclosed
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-07 — — US disclosed
US-9145432-B2 Compounds useful in various fields of a lubricant FUJIFILM CORPORATION (JP) 2015-09-29 — — US disclosed
US-9145432-B2 Compounds useful in various fields of a lubricant FUJIFILM CORPORATION (JP) 2015-09-29 — — US disclosed
US-9080127-B2 Composition, compound and film forming method FUJIFILM CORPORATION (JP) 2015-07-14 — — US disclosed
US-9080127-B2 Composition, compound and film forming method FUJIFILM CORPORATION (JP) 2015-07-14 — — US disclosed
US-20140012028-A1 COMPOUND FUJIFILM CORPORATION (JP) 2014-01-09 — — US disclosed
US-20140012028-A1 COMPOUND FUJIFILM CORPORATION (JP) 2014-01-09 — — US disclosed
US-8524644-B2 Composition and method for forming coating film FUJIFILM CORPORATION (JP) 2013-09-03 — — US disclosed
US-8524644-B2 Composition and method for forming coating film FUJIFILM CORPORATION (JP) 2013-09-03 — — US disclosed
US-20120201962-A1 COMPOSITION, COMPOUND AND FILM FORMING METHOD FUJIFILM CORPORATION (JP) 2012-08-09 — — US disclosed
US-20120201962-A1 COMPOSITION, COMPOUND AND FILM FORMING METHOD FUJIFILM CORPORATION (JP) 2012-08-09 — — US disclosed
US-20110034357-A1 COMPOSITION AND METHOD FOR FORMING COATING FILM FUJIFILM CORPORATION (JP) 2011-02-10 — — US disclosed
US-20110034357-A1 COMPOSITION AND METHOD FOR FORMING COATING FILM FUJIFILM CORPORATION (JP) 2011-02-10 — — US disclosed
US-20110015422-A1 COMPOUND FUJIJILM CORPORATION (JP) 2011-01-20 — — US disclosed
US-20110015422-A1 COMPOUND FUJIJILM CORPORATION (JP) 2011-01-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120201962-A1 COMPOSITION, COMPOUND AND FILM FORMING METHOD PYM1, DEGS1, ALK ALDH1A1 2620/4885LMNA 736/4885HSD17B10 3164/4885
US-20140012028-A1 COMPOUND ALK, CCNL2, ACSL3 ALDH1A1 770/4885LMNA 1144/4885HSD17B10 2304/4885
US-20110015422-A1 COMPOUND ALK, DEGS1, CACNA1A ALDH1A1 1189/4885LMNA 742/4885HSD17B10 1350/4885
US-20050085508-A1 Novel 4-(2-furoyl) aminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same OPRM1, OPRD1, HRH4 ALDH1A1 2958/4885LMNA 4826/4885HSD17B10 4116/4885
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF SGMS2, SGMS1, ARG2 ALDH1A1 2532/4885LMNA 1364/4885HSD17B10 1539/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.